Name: BMS-901715
Rating: 5 (10 reviews)

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结构编辑

类似物检索

HIT ID:HIT212671083
Cas No:1699861-37-4
常用名:BMS-901715
IUPAC:3-({5-[(4-aminopiperidin-1-yl)methyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl}amino)-5-[2-(propan-2-yl)-2H-1,2,3,4-tetrazol-5-yl]phenol
IUPAC:3-({5-[(4-aminopiperidin-1-yl)methyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl}amino)-5-[2-(propan-2-yl)-2H-1,2,3,4-tetrazol-5-yl]phenol
InChI key:CNACSDYVLFCDEW-UHFFFAOYSA-N

分子式:C22H28N10O
分子量:448.535
氢键供体数 (HBD):3
氢键受体数 (HBA):9
LogP:1.3945439
SMILES:CC(C)n1nnc(n1)-c1cc(O)cc(Nc2ncnn3ccc(CN4CCC(N)CC4)c23)c1
SMILES:CC(C)n1nnc(n1)-c1cc(O)cc(Nc2ncnn3ccc(CN4CCC(N)CC4)c23)c1

BMS-901715 is an effective and selective inhibitor of adapter protein-2 associated kinase 1 (AAK1; IC50: 3.3 nM).

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